Reaction Details Report a problem with these data
Target
Sterol O-acyltransferase 1
Ligand
BDBM50038925
Substrate
n/a
Meas. Tech.
ChEMBL_28505 (CHEMBL645934)
IC50
149±n/a nM
Citation
 Tawada, H; Harcourt, M; Kawamura, N; Kajino, M; Ishikawa, E; Sugiyama, Y; Ikeda, H; Meguro, K Novel acyl-CoA:cholesterol acyltransferase inhibitors. Synthesis and biological activity of 3-quinolylurea derivatives. J Med Chem 37:2079-84 (1994) [PubMed]  Article 
Target
Name:
Sterol O-acyltransferase 1
Synonyms:
ACAT-1 | Acact | Acat | Cholesterol acyltransferase 1 | SOAT1_RAT | Soat1 | Sterol O-acyltransferase, Soat
Type:
PROTEIN
Mol. Mass.:
64165.56
Organism:
Rattus norvegicus
Description:
ChEMBL_28796
Residue:
545
Sequence:
MVGEETSLRNRLSRSAENPEQDEAQKNLLDTHRNGHITMKQLIAKKRQLAAEAEELKPLFLKEVGCHFDDFVTNLIDKSASLDNGGCALTTFSILEEMKNNHRAKDLRAPPEQGKIFISRRSLLDELFEVDHIRTIYHMFIALLIIFILSTLVVDYIDEGRLVLEFSLLAYAFGQFPIVIWTWWAMFLSTLAIPYFLFQRWAHGYSKSSHPLIYSLIHGAFFLVFQLGILGFIPTYVVLAYTLPPASRFILILEQIRLVMKAHSYVRENVPRVLSAAKEKSSTVPVPTVNQYLYFLFAPTLIYRDSYPRTPTVRWGYVAMQFLQVFGCLFYVYYIFERLCAPLFRNIKQEPFSARVLVLCVFNSILPGVLMLFLSFFAFLHCWLNAFAEMLRFGDRMFYKDWWNSTSYSNYYRTWNVVVHDWLYYYVYKDLLWFFSKRFRPAAMLAVFALSAVVHEYALAVCLSYFYPVLFVLFMFFGMAFNFIVNDSRKRPVWNIMVRASLFLGHGVILCFYSQEWYARQRCPLKNPTFLDYVRPRTWTCRYVF
  
Inhibitor
Name:
BDBM50038925
Synonyms:
1-[4-(2-Chloro-phenyl)-5-methyl-quinolin-3-yl]-3-(2,4-difluoro-phenyl)-urea | CHEMBL433299
Type:
Small organic molecule
Emp. Form.:
C23H16ClF2N3O
Mol. Mass.:
423.842
SMILES:
Cc1cccc2ncc(NC(=O)Nc3ccc(F)cc3F)c(-c3ccccc3Cl)c12 |(1.78,-4.99,;1.77,-3.45,;.43,-2.69,;.43,-1.15,;1.76,-.38,;3.1,-1.15,;4.42,-.37,;5.76,-1.13,;5.77,-2.68,;7.1,-3.44,;8.43,-2.67,;8.43,-1.13,;9.78,-3.44,;9.78,-4.98,;8.45,-5.75,;8.45,-7.29,;9.81,-8.05,;9.81,-9.59,;11.14,-7.26,;11.11,-5.72,;12.44,-4.95,;4.44,-3.46,;4.44,-5,;3.1,-5.76,;3.1,-7.3,;4.44,-8.06,;5.77,-7.29,;5.79,-5.76,;7.33,-5.76,;3.1,-2.69,)|
Structure:
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